SCHEMBL12353093

SCHEMBL12353093

C=C1O[C@H](C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 2/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ POLB P06746 1/20 0.34
▸ ABCB1 P08183 2/20 0.32
▸ PRKCA P17252 2/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ PRKCG P05129 1/20 0.31
▸ PRKCB P05771 1/20 0.31
▸ PRKCH P24723 1/20 0.31
▸ PRKCE Q02156 1/20 0.31
▸ PRKCQ Q04759 1/20 0.31
▸ PRKCD Q05655 1/20 0.31
▸ PRKD1 Q15139 1/20 0.31
▸ TSHR P16473 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7153575 0.81 OGA (0.38) POLBABCB1PRKCAPRKD3PRKCG
SCHEMBL7148699 0.81 OGA (0.38) POLBABCB1PRKCAPRKD3PRKCG
SCHEMBL26484340 0.80 CA9 (0.36) CA9CA12CA1CA2POLB
SCHEMBL7149600 0.79 OGA (0.33) POLBABCB1
SCHEMBL7153659 0.79 OGA (0.33) POLBABCB1
SCHEMBL7146461 0.79 OGA (0.33) POLBABCB1
SCHEMBL7151005 0.75 TSHR (0.48) CA9CA12CA1CA2TSHR
SCHEMBL15326611 0.74 POLB (0.39) CA9CA12CA1CA2POLB
SCHEMBL24024779 0.73 CA9 (0.58) CA9CA12CA1CA2POLB
SCHEMBL19806807 0.73 CA9 (0.58) CA9CA12CA1CA2POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011102552-A1 ANTIBODY AGAINST A BAND LIPOPOLYSACCHARIDE OF PSEUDOMONAS AERUGINOSA MEIJI SEIKA KAISHA, LTD. (JP) 2011-08-25 — — WO disclosed
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